1-azoniabicyclo[2.2.2]octane-4-carboxylate

Systemtic Name: 1-azoniabicyclo[2.2.2]octane-4-carboxylate Openeye Name: quinuclidin-1-ium-4-carboxylate CAS Name: 1-azoniabicyclo[2.2.2]octane-4-carboxylate IUPAC Name: 1-azoniabicyclo[2.2.2]octane-4-carboxylate Traditional Name: quinuclidin-1-ium-4-carboxylate Formula: C8H13NO2 MolecularWeight: 155.19432

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1(CC2)C(=O)[O-]

Isomeric SMILES

C1C[NH+]2CCC1(CC2)C(=O)[O-]

InChI

InChI=1S/C8H13NO2/c10-7(11)8-1-4-9(5-2-8)6-3-8/h1-6H2,(H,10,11)